SCHEMBL2808768

SCHEMBL2808768

[CH2]c1cccc(CCO)c1CCO

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.34
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8918996 0.84 TDP1 (0.42) TDP1ALDH1A1TSHRHTT
SCHEMBL7942321 0.80 TDP1 (0.36) TDP1
SCHEMBL325674 0.79 TDP1 (0.44) TDP1ALDH1A1TSHRHTT
SCHEMBL5596024 0.76 TDP1 (0.36) TDP1ALDH1A1TSHRHTT
SCHEMBL583883 0.76 HSPA5 (0.41) TDP1ALDH1A1TSHR
SCHEMBL529644 0.74 ALDH1A1 (0.32) TDP1ALDH1A1TSHRHTT
SCHEMBL4386413 0.74 ALDH1A1 (0.39) TDP1ALDH1A1TSHRHTT
SCHEMBL818006 0.74 KDM4E (0.35) ALDH1A1TSHR
SCHEMBL1224647 0.74 TDP1 (0.34) TDP1ALDH1A1TSHRHTT
SCHEMBL2903703 0.73 PNMT (0.38) TDP1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100239679-A1 ENHANCED RETENTION CAPABILITIES THROUGH METHODS COMPRISING SURFACE TREATMENT OF FUNCTIONAL PARTICULATE CARRIER MATERIALS, AND FUNCTIONAL PARTICULATE CARRIER MATERIALS MADE THEREFROM WORLD MINERALS, INC. (US) 2010-09-23 US disclosed